0 mol 44 unq 0 iso 0 dist 8.44721 10.585 9.71891 5.57404 7.55822 6.18128 numMergedOcc 0
1 mol 44 unq 0 iso 1 dist 8.44721 5.57404 7.55822 10.585 9.71891 6.18128 numMergedOcc 0
2 mol 44 unq 1 iso 0 dist 5.31062 9.21621 9.71891 7.08048 7.55822 6.18128 numMergedOcc 0
3 mol 44 unq 1 iso 1 dist 5.31062 7.08048 7.55822 9.21621 9.71891 6.18128 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 9.12746 5.83041 7.11102 9.02154 8.48054 4.49719 numMergedOcc 0
5 mol 56 unq 0 iso 1 dist 9.12746 9.02154 8.48054 5.83041 7.11102 4.49719 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 6.75545 7.43387 6.59983 4.11905 9.12636 7.15048 numMergedOcc 0
7 mol 68 unq 0 iso 1 dist 6.75545 4.11905 9.12636 7.43387 6.59983 7.15048 numMergedOcc 0
8 mol 81 unq 0 iso 0 dist 5.9013 4.79903 8.18695 11.2512 7.82027 12.8822 numMergedOcc 0
9 mol 81 unq 0 iso 1 dist 5.9013 11.2512 7.82027 4.79903 8.18695 12.8822 numMergedOcc 0
10 mol 83 unq 0 iso 0 dist 7.0847 12.2484 8.79457 13.6357 9.25264 14.6805 numMergedOcc 0
11 mol 83 unq 0 iso 1 dist 7.0847 13.6357 9.25264 12.2484 8.79457 14.6805 numMergedOcc 0
12 mol 83 unq 1 iso 0 dist 5.8981 12.8549 8.79457 6.82052 9.25264 14.6805 numMergedOcc 0
13 mol 83 unq 1 iso 1 dist 5.8981 6.82052 9.25264 12.8549 8.79457 14.6805 numMergedOcc 0
14 mol 151 unq 0 iso 0 dist 5.37884 4.51635 8.13302 5.24414 5.11555 6.91746 numMergedOcc 0
15 mol 151 unq 0 iso 1 dist 5.37884 5.24414 5.11555 4.51635 8.13302 6.91746 numMergedOcc 0
16 mol 151 unq 1 iso 0 dist 5.37884 4.51635 8.13302 7.9137 8.29457 12.42 numMergedOcc 0
17 mol 151 unq 1 iso 1 dist 5.37884 7.9137 8.29457 4.51635 8.13302 12.42 numMergedOcc 0
18 mol 151 unq 1 iso 0 dist 5.37884 5.24414 5.11555 7.9137 8.29457 9.66427 numMergedOcc 0
19 mol 151 unq 1 iso 1 dist 5.37884 7.9137 8.29457 5.24414 5.11555 9.66427 numMergedOcc 0
20 mol 151 unq 2 iso 0 dist 6.24917 8.56008 8.13302 5.34678 5.11555 6.91746 numMergedOcc 0
21 mol 151 unq 2 iso 1 dist 6.24917 5.34678 5.11555 8.56008 8.13302 6.91746 numMergedOcc 0
22 mol 151 unq 3 iso 0 dist 6.24917 8.56008 8.13302 4.83603 8.29457 12.42 numMergedOcc 0
23 mol 151 unq 3 iso 1 dist 6.24917 4.83603 8.29457 8.56008 8.13302 12.42 numMergedOcc 0
24 mol 151 unq 3 iso 0 dist 6.24917 5.34678 5.11555 4.83603 8.29457 9.66427 numMergedOcc 0
25 mol 151 unq 3 iso 1 dist 6.24917 4.83603 8.29457 5.34678 5.11555 9.66427 numMergedOcc 0
26 mol 151 unq 4 iso 0 dist 7.64435 4.51635 9.42062 5.24414 8.8107 6.91746 numMergedOcc 0
27 mol 151 unq 4 iso 1 dist 7.64435 5.24414 8.8107 4.51635 9.42062 6.91746 numMergedOcc 0
28 mol 286 unq 0 iso 0 dist 6.57496 7.22566 9.96295 5.79125 8.95266 11.5223 numMergedOcc 0
29 mol 286 unq 0 iso 1 dist 6.57496 5.79125 8.95266 7.22566 9.96295 11.5223 numMergedOcc 0
30 mol 286 unq 1 iso 0 dist 7.9554 5.71244 9.96295 9.73618 8.95266 11.5223 numMergedOcc 0
31 mol 286 unq 1 iso 1 dist 7.9554 9.73618 8.95266 5.71244 9.96295 11.5223 numMergedOcc 0
32 mol 287 unq 0 iso 0 dist 7.86603 11.5428 6.08044 14.8583 8.8956 6.13067 numMergedOcc 0
33 mol 287 unq 0 iso 1 dist 7.86603 14.8583 8.8956 11.5428 6.08044 6.13067 numMergedOcc 0
34 mol 287 unq 1 iso 0 dist 7.17626 5.60788 6.08044 10.718 8.8956 6.13067 numMergedOcc 0
35 mol 287 unq 1 iso 1 dist 7.17626 10.718 8.8956 5.60788 6.08044 6.13067 numMergedOcc 0
36 mol 288 unq 0 iso 0 dist 7.86603 11.5428 6.08044 14.8583 8.8956 6.13067 numMergedOcc 0
37 mol 288 unq 0 iso 1 dist 7.86603 14.8583 8.8956 11.5428 6.08044 6.13067 numMergedOcc 0
38 mol 288 unq 1 iso 0 dist 7.17626 5.60788 6.08044 10.718 8.8956 6.13067 numMergedOcc 0
39 mol 288 unq 1 iso 1 dist 7.17626 10.718 8.8956 5.60788 6.08044 6.13067 numMergedOcc 0
40 mol 289 unq 0 iso 0 dist 7.86603 11.5428 6.08044 14.8583 8.8956 6.13067 numMergedOcc 0
41 mol 289 unq 0 iso 1 dist 7.86603 14.8583 8.8956 11.5428 6.08044 6.13067 numMergedOcc 0
42 mol 289 unq 1 iso 0 dist 7.17626 5.60788 6.08044 10.718 8.8956 6.13067 numMergedOcc 0
43 mol 289 unq 1 iso 1 dist 7.17626 10.718 8.8956 5.60788 6.08044 6.13067 numMergedOcc 0
